2,2-bis[(nonanoyloxy)methyl]butyl Nonanoate (non-preferred Name)
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-95f2a488190f7c90
Changes
56| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 13,105 | bootstrap_labels | prefLabel | — | [{"@value":"2,2-bis[(nonanoyloxy)methyl]butyl nonanoate (non-preferred name)","@language":"en","source":{"prov:wasGener… | Bootstrapped prefLabel from legacy name field |
| 13,106 | bootstrap_labels | name | 2,2-bis[(nonanoyloxy)methyl]butyl nonanoate (non-preferred name) | — | Purged legacy name field to enforce prefLabel usage |
| 13,107 | bootstrap_labels | synonyms | ["organic","2-ethyl-2-[[(1-oxononyl)oxy]methyl]propane-1,3-diyldinonan-1-oate","hatcol2939","oxlubel9-tmp"] | [] | Removed legacy synonyms field in favor of structured labels |
| 47,269 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 47,270 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 74,281 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 74,282 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 77,071 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 77,072 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 84,903 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 84,904 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 85,107 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 85,108 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 86,329 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 86,330 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 101,905 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 101,906 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 108,877 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 108,878 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 151,493 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 151,494 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 162,541 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 162,542 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 162,787 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 162,788 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 165,877 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 165,878 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 171,701 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 171,702 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 217,675 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,132 | normalize_name_case | prefLabel | [{"@value":"2,2-bis[(nonanoyloxy)methyl]butyl nonanoate (non-preferred name)","@language":"en","source":{"prov:wasGener… | [{"@value":"2,2-bis[(nonanoyloxy)methyl]butyl Nonanoate (non-preferred Name)","@language":"en","source":{"prov:wasGener… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,616 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,617 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,618 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J114.966K","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['126-57-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[31351]; selected_pubchem_cids=[31351]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| 251,899 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | rdkit_pre_consensus from 'CCCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC'; added: molecular_mass, monoisotopic_mass |
| 259,615 | consensus_match | altLabel | [] | [{"@value":"1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trinonanoate","@language":"en","source":{"prov:wasGeneratedBy"… | group_key=2,2-bis[(nonanoyloxy)methyl]butylnonanoate(non-preferredname)||dimension=Environmental > media=Air > strata=Unknown; cas=126-57-8; added Common Chemistry CAS names as altLabel: 1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trinonanoate, 2-Ethyl-2-[[(1-oxononyl)oxy]methyl]propane-1,3-diyl dinonan-1-oate, Emery 2934, Emery 6701, Nonanoic acid, 1,1′-[2-ethyl-2-[[(1-oxononyl)oxy]methyl]-1,3-propanediyl] ester, Nonanoic acid, 2-ethyl-2-[[(1-oxononyl)oxy]methyl]-1,3-propanediyl ester, Nonanoic acid, triester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, Reolube LT 2700, TMP trinonanoate, TMP tripelargonate, TMP-C 9, Trimethylolpropane trinonanoate, Trimethylolpropane tripelargonate; object_uuid=fo-95f2a488190f7c90 |
| 259,616 | consensus_match | cas_match_labels | — | {"126-57-8":"exactMatch"} | group_key=2,2-bis[(nonanoyloxy)methyl]butylnonanoate(non-preferredname)||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'126-57-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-95f2a488190f7c90: {'126-57-8': 'exactMatch'} |
| 277,088 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trinonanoate' |
| 283,747 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6",… | rdkit_post_consensus from 'CCC(CO)(CO)CO.CCCCCCCCC(=O)O.CCCCCCCCC(=O)O.CCCCCCCCC(=O)O'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,690 | withhold_contradicted_composition | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C33H62O6"]… | withhold_contradicted_composition: the registry registers [(('C', 33), ('O', 6))], contradicting ['C33H68O9'] from ['rdkit_post_consensus']; withdrew inchi2d_key_string x1, molecular_formula x1, molecular_mass x1, monoisotopic_mass x1 |
| 289,958 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trinonanoate","@language":"en","source":{"prov:wasGeneratedBy"… | [{"@value":"1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trinonanoate","@language":"en","source":{"prov:wasGeneratedBy"… | Removed 2 catalogue altLabel value(s): 'Emery 2934' (trade name), 'Emery 6701' (trade name) |
| 304,700 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/10c22768-f6fa-… | associations resolved on the elementary layer |
| 318,194 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/38a84612-a0c3-… | associations resolved on the elementary layer |
| 319,588 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3d67e0bd-d455-… | associations resolved on the elementary layer |
| 323,504 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/49679404-523c-… | associations resolved on the elementary layer |
| 323,606 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/49ccddd3-c896-… | associations resolved on the elementary layer |
| 324,217 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4c0a553c-53b8-… | associations resolved on the elementary layer |
| 331,986 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/57a94ee2-d109-… | associations resolved on the elementary layer |
| 335,472 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/63a1ebde-c0cd-… | associations resolved on the elementary layer |
| 356,800 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/aafb66c3-9197-… | associations resolved on the elementary layer |